SCHEMBL8405684

SCHEMBL8405684

CC(C)Oc1ccc(OCCCOc2c(C(C)C)cc(OCC=C(Cl)Cl)cc2C(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 4/20 0.36
KMT2A Q03164 2/20 0.36
GLRA1 P23415 1/20 0.33
CARM1 Q86X55 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
NSD2 O96028 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8405713 0.98 HTT (0.40) HTTALDH1A1KDM4EKMT2AGLRA1
SCHEMBL8405781 0.89 HTT (0.40) HTTALDH1A1KMT2AGLRA1L3MBTL1
SCHEMBL8405423 0.88 HTT (0.40) HTTALDH1A1KDM4EGLRA1
SCHEMBL8406348 0.87 HTT (0.40) HTTALDH1A1KDM4EKMT2ASMN1; SMN2
SCHEMBL8409111 0.87 HTT (0.40) HTTALDH1A1KMT2AGLRA1MEN1
SCHEMBL8407345 0.86 HTT (0.40) HTTALDH1A1KDM4EGLRA1L3MBTL1
SCHEMBL8409446 0.85 PPARA (0.38) HTT
SCHEMBL8405514 0.85 HTT (0.41) HTTALDH1A1KDM4EKMT2ASMN1; SMN2
SCHEMBL8407599 0.84 HTT (0.40) HTTALDH1A1KDM4EKMT2ASMN1; SMN2
SCHEMBL8408524 0.83 HTT (0.37) HTTGLRA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5872137-A AROMATIC OXY DIHALOPRENE COMPOUNDS INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-16 US disclosed
EP-0722430-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 1998-10-21 EP disclosed